SCHEMBL16952094

SCHEMBL16952094

CSc1cccc([C](C)CO)c1F

nearest known ligand 0.37

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 2/20 0.37
▸ KMT2A Q03164 4/20 0.34
▸ GAA P10253 1/20 0.34
▸ ALDH1A1 P00352 3/20 0.34
▸ MEN1 O00255 2/20 0.33
▸ HPGD P15428 4/20 0.33
▸ KDM4E B2RXH2 2/20 0.32
▸ NPSR1 Q6W5P4 1/20 0.32
▸ L3MBTL1 Q9Y468 1/20 0.32
▸ MAPT P10636 2/20 0.32
▸ RAB9A P51151 2/20 0.32
▸ NPC1 O15118 1/20 0.32
▸ SMN1; SMN2 Q16637 1/20 0.32
▸ HSD17B10 Q99714 1/20 0.32
▸ HTT P42858 1/20 0.32

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL16952148 0.81 ALDH1A1 (0.37) LMNAKMT2AGAAALDH1A1MEN1
SCHEMBL16961356 0.79 KMT2A (0.36) LMNAKMT2AGAAALDH1A1MEN1
SCHEMBL16961211 0.79 KMT2A (0.34) LMNAKMT2AGAAALDH1A1MEN1
SCHEMBL16956070 0.77 MAPT (0.37) LMNAKMT2AGAAALDH1A1MEN1
SCHEMBL16954240 0.77 CES2 (0.52) KMT2AGAAALDH1A1MEN1HPGD
SCHEMBL16950644 0.76 ADRB1 (0.39) LMNAKMT2AALDH1A1MEN1HPGD
SCHEMBL16953964 0.76 KAT6A (0.39) KMT2AALDH1A1MEN1HPGDKDM4E
SCHEMBL16961299 0.75 ALDH1A1 (0.35) LMNAKMT2AGAAALDH1A1MEN1
SCHEMBL16953106 0.74 CES2 (0.31) —
SCHEMBL16959071 0.74 CTSL (0.35) HPGDRAB9ANPC1SMN1; SMN2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2900645-A1 3-PHENYLISOXAZOLIN DERIVATIVES WITH HERBICIDAL ACTION Bayer CropScience AG (DE) 2015-08-05 — — EP disclosed
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